ethyl 7-[4-(4-ethoxyphenyl)buta-1,3-diynyl]-2-[2-(4-ethoxyphenyl)ethynyl]-1-benzofuran-5-carboxylate

Systemtic Name: ethyl 7-[4-(4-ethoxyphenyl)buta-1,3-diynyl]-2-[2-(4-ethoxyphenyl)ethynyl]-1-benzofuran-5-carboxylate Openeye Name: ethyl 7-[4-(4-ethoxyphenyl)buta-1,3-diynyl]-2-[2-(4-ethoxyphenyl)ethynyl]benzofuran-5-carboxylate CAS Name: 7-[4-(4-ethoxyphenyl)buta-1,3-diynyl]-2-[2-(4-ethoxyphenyl)ethynyl]-5-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(4-ethoxyphenyl)buta-1,3-diynyl]-2-[2-(4-ethoxyphenyl)ethynyl]-1-benzofuran-5-carboxylate Traditional Name: 7-(4-p-phenetylbuta-1,3-diynyl)-2-(2-p-phenetylethynyl)benzofuran-5-carboxylic acid ethyl ester Formula: C33H26O5 MolecularWeight: 502.55654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C#CC#CC2=CC(=CC3=C2OC(=C3)C#CC4=CC=C(C=C4)OCC)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C#CC#CC2=CC(=CC3=C2OC(=C3)C#CC4=CC=C(C=C4)OCC)C(=O)OCC

InChI

InChI=1S/C33H26O5/c1-4-35-29-16-11-24(12-17-29)9-7-8-10-26-21-28(33(34)37-6-3)22-27-23-31(38-32(26)27)20-15-25-13-18-30(19-14-25)36-5-2/h11-14,16-19,21-23H,4-6H2,1-3H3